Information card for entry 4118940

Structure parameters

• Common name: Fe-sidorenkite
• Formula: C Fe Na3 O7 P
• Calculated formula: C Fe Na3 O7 P
• Title of publication: Synthesis, Computed Stability, and Crystal Structure of a New Family of Inorganic Compounds: Carbonophosphates
• Authors of publication: Hailong Chen; Geoffroy Hautier; Gerbrand Ceder
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2012
• Journal volume: 134
• Pages of publication: 19619 - 19627
• a: 8.95419 ± 0.00013 Å
• b: 6.61129 ± 0.00005 Å
• c: 5.16023 ± 0.00005 Å
• α: 90°
• β: 89.6001 ± 0.0013°
• γ: 90°
• Cell volume: 305.472 ± 0.006 ų
• Cell temperature: 300 K
• Ambient diffraction temperature: 300 K
• Number of distinct elements: 5
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Goodness-of-fit parameter for all reflections: 1.83
• Method of determination: powder diffraction
• Diffraction radiation wavelength: 0.775192 Å
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No